SCHEMBL1785618

SCHEMBL1785618

CCCCC(C)C(O)/C=C/C(C)=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.42
BACE1 P56817 1/20 0.42
ASAH2 Q9NR71 1/20 0.36
CA2 P00918 2/20 0.34
MAPK1 P28482 2/20 0.34
MAPT P10636 2/20 0.34
TRPA1 O75762 1/20 0.34
DDAH1 O94760 1/20 0.34
GAPDH P04406 1/20 0.34
GPR84 Q9NQS5 3/20 0.33
CA1 P00915 2/20 0.33
FFAR1 O14842 1/20 0.33
OXER1 Q8TDS5 1/20 0.33
PPARG P37231 2/20 0.33
TP53 P04637 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
GPR132 Q9UNW8 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1785620 1.00 ACHE (0.42) ACHEBACE1ASAH2CA2MAPK1
SCHEMBL1786419 0.89 METAP1 (0.34) ACHEBACE1
SCHEMBL1786421 0.89 METAP1 (0.34) ACHEBACE1
SCHEMBL1783215 0.80 MME (0.32) GAPDH
SCHEMBL1783214 0.80 MME (0.32) GAPDH
SCHEMBL1782776 0.79 ACHE (0.59) ACHEBACE1MAPTTRPA1DDAH1
SCHEMBL11198762 0.79 ACHE (0.38) ACHEBACE1ASAH2CA2MAPK1
SCHEMBL8948270 0.79 ACHE (0.42) ACHEBACE1CA2MAPK1MAPT
SCHEMBL1782779 0.79 ACHE (0.59) ACHEBACE1MAPTTRPA1DDAH1
SCHEMBL8948267 0.79 ACHE (0.42) ACHEBACE1CA2MAPK1MAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8632792-B2 Cooling sensation agent composition and sensory stimulation agent composition TAKASAGO INTERNATIONAL CORPORATION (JP) 2014-01-21 US disclosed
US-20110117147-A1 COOLING SENSATION AGENT COMPOSITION AND SENSORY STIMULATION AGENT COMPOSITION TAKASAGO INTERNATIONAL CORPORATION (JP) 2011-05-19 US disclosed
WO-2009123355-A2 COOLING SENSATION AGENT COMPOSITION AND SENSORY STIMULATION AGENT COMPOSITION TAKASAGO INTERNATIONAL CORPORATION (JP) 2009-10-08 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110117147-A1 COOLING SENSATION AGENT COMPOSITION AND SENSORY STIMULATION AGENT COMPOSITION TRPA1, HRH1, HRH2 ACHE 1079/4885BACE1 2318/4885ASAH2 3846/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.